ChemicalBook--->CAS DataBase List--->594-70-7

594-70-7

594-70-7 Structure

594-70-7 Structure
IdentificationBack Directory
[Name]

2-Methyl-2-nitropropane
[CAS]

594-70-7
[Synonyms]

(CH3)3CNO2
2-Nitroisobutane
nitrotert-butane
TERT-NITROBUTANE
Nitro-tert.-butan
Trimethylnitromethane
tert-Nitrobutane,98+%
Trimethylnitro-methane
2-METHYL-2-NITROPROPANE
2-methyl-2-nitro-propan
2-Nitro-2-methylpropane
Propane,2-methyl-2-nitro-
1,1-Dimethyl-1-nitroethane
1,1-Dimethyl-2-nitroethane
2-Methyl-2-nitropropane,99%
2-Methyl-2-nitropropane ,98.5%
2-Methyl-2-nitropropane, 99% 25GR
[EINECS(EC#)]

209-851-4
[Molecular Formula]

C4H9NO2
[MDL Number]

MFCD00007393
[MOL File]

594-70-7.mol
[Molecular Weight]

103.12
Chemical PropertiesBack Directory
[Appearance]

clear colourless liquid after melting
[Melting point ]

24 °C
[Boiling point ]

126-127 °C(lit.)
[density ]

0.95 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.4(lit.)
[Fp ]

67 °F
[storage temp. ]

Flammables area
[form ]

Crystalline Powder, Crystals, or Flakes
[color ]

White
[Water Solubility ]

Insoluble
[BRN ]

1744184
[Dielectric constant]

23.68
[InChI]

1S/C4H9NO2/c1-4(2,3)5(6)7/h1-3H3
[InChIKey]

AIMREYQYBFBEGQ-UHFFFAOYSA-N
[SMILES]

CC(C)(C)[N+]([O-])=O
[NIST Chemistry Reference]

Propane, 2-methyl-2-nitro-(594-70-7)
[EPA Substance Registry System]

Propane, 2-methyl-2-nitro-(594-70-7)
Hazard InformationBack Directory
[Chemical Properties]

clear colourless liquid after melting
[Uses]

2-Methyl-2-nitropropane is a useful reagent in the preparation of various other chemical compounds including amines, alkynylnitrones, amides and nitriles.
[General Description]

Photodissociation of 2-methyl-2-nitropropane at 193 and 248nm leads to the formation of OH fragment and electronically excited NO2. Hydrolysis reaction of 2-methyl-2-nitropropane in the presence of platinum-alumina catalyst yields N2O.
[Synthesis]

2-Methyl-2-nitropropane was prepared as follows: 130gKMnO4, 600mL water into a 1L three-necked flask, strong stirring, 29mL (20g) t-butylamine through the dropping funnel for 10min drops into the flask, the temperature was gradually increased to 55 ℃ in 2
Safety DataBack Directory
[Hazard Codes ]

F,Xi
[Risk Statements ]

11-36/37/38
[Safety Statements ]

16-26-36/37/39-37/39
[RIDADR ]

UN 1993 3/PG 2
[WGK Germany ]

3
[TSCA ]

Yes
[HazardClass ]

4.1
[PackingGroup ]

II
[HS Code ]

29049090
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Eye Irrit. 2
Flam. Liq. 2
Skin Irrit. 2
STOT SE 3
Spectrum DetailBack Directory
[Spectrum Detail]

2-Methyl-2-nitropropane(594-70-7)MS
2-Methyl-2-nitropropane(594-70-7)1HNMR
2-Methyl-2-nitropropane(594-70-7)13CNMR
2-Methyl-2-nitropropane(594-70-7)IR1
2-Methyl-2-nitropropane(594-70-7)Raman
2-Methyl-2-nitropropane(594-70-7)ESR
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